SCHEMBL19329276

SCHEMBL19329276

COCc1ccc(-c2cc3c(cc2F)ncc2c3n([C@@H]3CCCOC3)c(=O)n2C)cn1

nearest known ligand 0.84

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ ATM Q13315 20/20 0.84
▸ KCNH2 Q12809 8/20 0.84
▸ ATR Q13535 4/20 0.79
▸ MTOR P42345 5/20 0.72
▸ PIK3CA P42336 3/20 0.72

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL19346436 1.00 ATM (0.84) ATMKCNH2ATRMTORPIK3CA
SCHEMBL19329277 1.00 ATM (0.84) ATMKCNH2ATRMTORPIK3CA
SCHEMBL19329281 0.89 ATM (0.72) ATMKCNH2ATRMTORPIK3CA
SCHEMBL19329280 0.89 ATM (0.72) ATMKCNH2ATRMTORPIK3CA
SCHEMBL25351294 0.89 ATM (0.72) ATMKCNH2ATRMTORPIK3CA
SCHEMBL18843777 0.89 ATM (0.73) ATMKCNH2ATRMTORPIK3CA
SCHEMBL17246505 0.89 ATM (0.73) ATMKCNH2ATRMTORPIK3CA
SCHEMBL20006461 0.89 ATM (0.73) ATMKCNH2ATRMTORPIK3CA
SCHEMBL19329262 0.88 ATM (1.00) ATMKCNH2ATRMTORPIK3CA
SCHEMBL19329261 0.88 ATM (1.00) ATMKCNH2ATRMTORPIK3CA

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2017153578-A1 IMIDAZO[4,5-C]QUINOLIN-2-ONE COMPOUNDS AND THEIR USE IN TREATING CANCER ASTRAZENECA AB (SE) 2017-09-14 — — WO claimed
WO-2017153578-A1 IMIDAZO[4,5-C]QUINOLIN-2-ONE COMPOUNDS AND THEIR USE IN TREATING CANCER ASTRAZENECA AB (SE) 2017-09-14 — — WO disclosed
WO-2017153578-A1 IMIDAZO[4,5-C]QUINOLIN-2-ONE COMPOUNDS AND THEIR USE IN TREATING CANCER ASTRAZENECA AB (SE) 2017-09-14 — — WO disclosed
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